CID 5382471

5960-77-0

Structural Information

Molecular Formula
C16H13NO
SMILES
C/C(=N/O)/C1=CC2=C(C=C1)C3=CC=CC=C3C=C2
InChI
InChI=1S/C16H13NO/c1-11(17-18)13-8-9-16-14(10-13)7-6-12-4-2-3-5-15(12)16/h2-10,18H,1H3/b17-11-
InChIKey
NCXZQCXSDGLAOG-BOPFTXTBSA-N
Compound name
(NZ)-N-(1-phenanthren-2-ylethylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.09972 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.10700 149.9
[M+Na]+ 258.08894 159.1
[M-H]- 234.09244 155.8
[M+NH4]+ 253.13354 169.6
[M+K]+ 274.06288 154.2
[M+H-H2O]+ 218.09698 142.8
[M+HCOO]- 280.09792 173.6
[M+CH3COO]- 294.11357 163.1
[M+Na-2H]- 256.07439 159.5
[M]+ 235.09917 151.2
[M]- 235.10027 151.2
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.