CID 5888451

2-[4-[(z)-inden-1-ylidenemethyl]phenyl]guanidine

Structural Information

Molecular Formula
C17H15N3
SMILES
C1=CC=C\2C(=C1)C=C/C2=C/C3=CC=C(C=C3)N=C(N)N
InChI
InChI=1S/C17H15N3/c18-17(19)20-15-9-5-12(6-10-15)11-14-8-7-13-3-1-2-4-16(13)14/h1-11H,(H4,18,19,20)/b14-11-
InChIKey
BOGIJBDMOQJRFY-KAMYIIQDSA-N
Compound name
2-[4-[(Z)-inden-1-ylidenemethyl]phenyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.1266 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.13388 159.2
[M+Na]+ 284.11582 166.1
[M-H]- 260.11932 167.5
[M+NH4]+ 279.16042 177.9
[M+K]+ 300.08976 160.4
[M+H-H2O]+ 244.12386 151.4
[M+HCOO]- 306.12480 186.0
[M+CH3COO]- 320.14045 171.4
[M+Na-2H]- 282.10127 163.5
[M]+ 261.12605 155.5
[M]- 261.12715 155.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.