CID 17956664

78151-25-4

Structural Information

Molecular Formula

C₉H₁₈N₄O

SMILES

CC1(CC(C(N1O)(C)C)CN=[N+]=[N-])C

InChI

InChI=1S/C9H18N4O/c1-8(2)5-7(6-11-12-10)9(3,4)13(8)14/h7,14H,5-6H2,1-4H3

InChIKey

OOZJHQLYZLXPIF-UHFFFAOYSA-N

Compound name

3-(azidomethyl)-1-hydroxy-2,2,5,5-tetramethylpyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 198.14806 Da
Monoisotopic Mass: 2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	199.15534	138.1
[M+Na]+	221.13728	146.0
[M-H]-	197.14078	142.2
[M+NH4]+	216.18188	161.8
[M+K]+	237.11122	140.6
[M+H-H2O]+	181.14532	138.1
[M+HCOO]-	243.14626	164.7
[M+CH3COO]-	257.16191	186.6
[M+Na-2H]-	219.12273	146.8
[M]+	198.14751	135.6
[M]-	198.14861	135.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe