CID 282393

(1-tert-butylazetidin-2-yl)methanol

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)(C)N1CCC1CO
InChI
InChI=1S/C8H17NO/c1-8(2,3)9-5-4-7(9)6-10/h7,10H,4-6H2,1-3H3
InChIKey
VGWGGPWCDSSOEC-UHFFFAOYSA-N
Compound name
(1-tert-butylazetidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

143.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 133.4
[M+Na]+ 166.120228 139.2
[M-H]- 142.123734 134.3
[M+NH4]+ 161.164833 147.0
[M+K]+ 182.094168 141.3
[M+H-H2O]+ 126.128270 123.5
[M+HCOO]- 188.129211 150.8
[M+CH3COO]- 202.144861 177.5
[M+Na-2H]- 164.105676 138.5
[M]+ 143.13046142 141.0
[M]- 143.13155858 141.0
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