CID 65940647

1496189-92-4

Structural Information

Molecular Formula
C10H17NO
SMILES
CC(C)C1(CN(C1)CCC#C)O
InChI
InChI=1S/C10H17NO/c1-4-5-6-11-7-10(12,8-11)9(2)3/h1,9,12H,5-8H2,2-3H3
InChIKey
NUIWQHDYCIIOEW-UHFFFAOYSA-N
Compound name
1-but-3-ynyl-3-propan-2-ylazetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.13101 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.138286 134.3
[M+Na]+ 190.120228 141.7
[M-H]- 166.123734 134.4
[M+NH4]+ 185.164833 147.1
[M+K]+ 206.094168 142.9
[M+H-H2O]+ 150.128270 119.7
[M+HCOO]- 212.129211 146.9
[M+CH3COO]- 226.144861 190.4
[M+Na-2H]- 188.105676 137.6
[M]+ 167.13046142 136.4
[M]- 167.13155858 136.4
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.