CID 41904

56485-63-3

Structural Information

Molecular Formula
C13H19N
SMILES
CC1(CCCC2=CC=CC=C2C1)NC
InChI
InChI=1S/C13H19N/c1-13(14-2)9-5-8-11-6-3-4-7-12(11)10-13/h3-4,6-7,14H,5,8-10H2,1-2H3
InChIKey
AGFAUPFRODFMDX-UHFFFAOYSA-N
Compound name
N,6-dimethyl-5,7,8,9-tetrahydrobenzo[7]annulen-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.15175 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.159026 140.8
[M+Na]+ 212.140968 145.5
[M-H]- 188.144474 146.0
[M+NH4]+ 207.185573 161.9
[M+K]+ 228.114908 146.1
[M+H-H2O]+ 172.149010 136.0
[M+HCOO]- 234.149951 161.4
[M+CH3COO]- 248.165601 152.9
[M+Na-2H]- 210.126416 148.2
[M]+ 189.15120142 135.0
[M]- 189.15229858 135.0
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.