CID 122360901

(3-methyl-3h-diazirin-3-yl)methanol

Structural Information

Molecular Formula
C3H6N2O
SMILES
CC1(N=N1)CO
InChI
InChI=1S/C3H6N2O/c1-3(2-6)4-5-3/h6H,2H2,1H3
InChIKey
RIFDUEMPDUTSHB-UHFFFAOYSA-N
Compound name
(3-methyldiazirin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

86.04801 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 87.055286 118.0
[M+Na]+ 109.03723 131.3
[M+NH4]+ 104.08183 127.8
[M+K]+ 125.01117 126.1
[M-H]- 85.040734 124.7
[M+Na-2H]- 107.02268 128.0
[M]+ 86.047461 123.0
[M]- 86.048559 123.0
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

patents stripe