CID 15700

1785-74-6

Structural Information

Molecular Formula
C15H13NO
SMILES
C1CC2=CC=CC=C2C(=NO)C3=CC=CC=C31
InChI
InChI=1S/C15H13NO/c17-16-15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)15/h1-8,17H,9-10H2
InChIKey
BYNLMOBUYHLZQC-UHFFFAOYSA-N
Compound name
N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

223.09972 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.10700 146.2
[M+Na]+ 246.08894 153.1
[M-H]- 222.09244 152.9
[M+NH4]+ 241.13354 165.4
[M+K]+ 262.06288 152.7
[M+H-H2O]+ 206.09698 141.6
[M+HCOO]- 268.09792 168.0
[M+CH3COO]- 282.11357 158.7
[M+Na-2H]- 244.07439 155.1
[M]+ 223.09917 142.2
[M]- 223.10027 142.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe