CID 130146437

1822860-99-0

Structural Information

Molecular Formula
C9H18O2
SMILES
CC1(C(C(C1OC)(C)C)O)C
InChI
InChI=1S/C9H18O2/c1-8(2)6(10)9(3,4)7(8)11-5/h6-7,10H,1-5H3
InChIKey
IWGLREVJRBTNBB-UHFFFAOYSA-N
Compound name
3-methoxy-2,2,4,4-tetramethylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

158.13068 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.13796 133.2
[M+Na]+ 181.11990 141.5
[M-H]- 157.12340 136.8
[M+NH4]+ 176.16450 152.0
[M+K]+ 197.09384 143.7
[M+H-H2O]+ 141.12794 127.0
[M+HCOO]- 203.12888 153.3
[M+CH3COO]- 217.14453 181.8
[M+Na-2H]- 179.10535 138.6
[M]+ 158.13013 144.2
[M]- 158.13123 144.2
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