CID 13270447

90043-22-4

Structural Information

Molecular Formula
C8H10NOP
SMILES
CP1(=O)CC2=CC=CC=C2N1
InChI
InChI=1S/C8H10NOP/c1-11(10)6-7-4-2-3-5-8(7)9-11/h2-5H,6H2,1H3,(H,9,10)
InChIKey
HNYYFKLEBZRWRN-UHFFFAOYSA-N
Compound name
2-methyl-1,3-dihydro-1,2lambda5-benzazaphosphole 2-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.05 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.05728 133.9
[M+Na]+ 190.03922 143.1
[M-H]- 166.04272 134.9
[M+NH4]+ 185.08382 157.9
[M+K]+ 206.01316 140.0
[M+H-H2O]+ 150.04726 126.3
[M+HCOO]- 212.04820 160.6
[M+CH3COO]- 226.06385 174.8
[M+Na-2H]- 188.02467 138.0
[M]+ 167.04945 132.7
[M]- 167.05055 132.7
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.