CID 4962873

1803585-84-3

Structural Information

Molecular Formula
C14H23N
SMILES
CC(C)C(C1=CC=C(C=C1)C(C)(C)C)N
InChI
InChI=1S/C14H23N/c1-10(2)13(15)11-6-8-12(9-7-11)14(3,4)5/h6-10,13H,15H2,1-5H3
InChIKey
XESRPNFEVXAAIN-UHFFFAOYSA-N
Compound name
1-(4-tert-butylphenyl)-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.18304 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.19032 151.1
[M+Na]+ 228.17226 156.6
[M-H]- 204.17576 154.2
[M+NH4]+ 223.21686 170.1
[M+K]+ 244.14620 154.5
[M+H-H2O]+ 188.18030 145.5
[M+HCOO]- 250.18124 170.9
[M+CH3COO]- 264.19689 193.2
[M+Na-2H]- 226.15771 153.4
[M]+ 205.18249 149.7
[M]- 205.18359 149.7
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.